IFLAB-ZINC04249079 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.3710 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.0080 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6840 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.0280 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4060 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0870 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.5700 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 4.3820 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 5.6920 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 6.9690 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 7.9900 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 7.2740 0.2650 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 5.6050 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 4.3450 0.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.0820 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7660 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -2.1720 -1.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.2700 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -4.7590 -0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -6.1050 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -6.6480 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -8.0160 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -8.8460 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -8.3060 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -6.9380 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -10.5650 -0.9730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 1.8960 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.5620 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -0.5000 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 1.9590 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 4.0680 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 7.1350 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 9.0400 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -2.5600 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -4.6860 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -4.5690 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -6.0010 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -8.4390 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -8.9550 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -6.5180 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END